ethyl (Z)-3-[3-tert-butyl-5-(2-methyl-1-oxidanyl-propan-2-yl)-4-oxidanyl-phenyl]-2-(3-oxidanylidene-1,4-benzothiazin-4-yl)prop-2-enoate

Systemtic Name: ethyl (Z)-3-[3-tert-butyl-5-(2-methyl-1-oxidanyl-propan-2-yl)-4-oxidanyl-phenyl]-2-(3-oxidanylidene-1,4-benzothiazin-4-yl)prop-2-enoate Openeye Name: ethyl (Z)-3-[3-tert-butyl-4-hydroxy-5-(2-hydroxy-1,1-dimethyl-ethyl)phenyl]-2-(3-oxo-1,4-benzothiazin-4-yl)prop-2-enoate CAS Name: (Z)-3-[3-tert-butyl-4-hydroxy-5-(1-hydroxy-2-methylpropan-2-yl)phenyl]-2-(3-oxo-1,4-benzothiazin-4-yl)-2-propenoic acid ethyl ester IUPAC Name: ethyl (Z)-3-[3-tert-butyl-4-hydroxy-5-(1-hydroxy-2-methylpropan-2-yl)phenyl]-2-(3-oxo-1,4-benzothiazin-4-yl)prop-2-enoate Traditional Name: (Z)-3-[3-tert-butyl-4-hydroxy-5-(2-hydroxy-1,1-dimethyl-ethyl)phenyl]-2-(3-keto-1,4-benzothiazin-4-yl)acrylic acid ethyl ester Formula: C27H33NO5S MolecularWeight: 483.61962

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CC(=C(C(=C1)C(C)(C)CO)O)C(C)(C)C)N2C(=O)CSC3=CC=CC=C32

Isomeric SMILES

CCOC(=O)/C(=C/C1=CC(=C(C(=C1)C(C)(C)CO)O)C(C)(C)C)/N2C(=O)CSC3=CC=CC=C32

InChI

InChI=1S/C27H33NO5S/c1-7-33-25(32)21(28-20-10-8-9-11-22(20)34-15-23(28)30)14-17-12-18(26(2,3)4)24(31)19(13-17)27(5,6)16-29/h8-14,29,31H,7,15-16H2,1-6H3/b21-14-